==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=28-JUN-2013 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER CHAPERONE 10-APR-12 4EKZ . COMPND 2 MOLECULE: PROTEIN DISULFIDE-ISOMERASE; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR C.WANG,W.LI,J.REN,H.KE,W.GONG,W.FENG,C.-C.WANG . 469 3 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 26229.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 302 64.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 39 8.3 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 43 9.2 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 2 0.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 2 0.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-2), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-1), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+0), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+1), SAME NUMBER PER 100 RESIDUES . 41 8.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 48 10.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 118 25.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 7 1.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+5), SAME NUMBER PER 100 RESIDUES . 1 2 3 4 5 6 7 8 9 10 11 12 13 14 15 16 17 18 19 20 21 22 23 24 25 26 27 28 29 30 *** HISTOGRAMS OF *** . 0 0 0 0 1 2 2 1 2 0 2 3 0 0 0 0 1 0 1 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 3 1 1 1 1 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 PARALLEL BRIDGES PER LADDER . 0 4 1 0 1 3 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 0 0 0 3 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 LADDERS PER SHEET . # RESIDUE AA STRUCTURE BP1 BP2 ACC N-H-->O O-->H-N N-H-->O O-->H-N TCO KAPPA ALPHA PHI PSI X-CA Y-CA Z-CA 1 -14 A H > 0 0 175 0, 0.0 4,-0.6 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 -88.6 22.0 -5.1 3.9 2 -13 A H T 4 + 0 0 132 2,-0.2 3,-0.3 1,-0.2 5,-0.0 0.908 360.0 62.2 -87.9 -50.1 20.2 -8.0 2.3 3 -12 A S T 4 S+ 0 0 104 1,-0.3 -1,-0.2 3,-0.0 3,-0.1 0.604 132.4 10.6 -51.4 -8.5 18.8 -9.8 5.3 4 -11 A S T 4 S+ 0 0 103 1,-0.1 2,-0.4 0, 0.0 -1,-0.3 0.352 115.7 78.8-153.5 2.5 16.9 -6.5 5.7 5 -10 A G < - 0 0 27 -4,-0.6 2,-0.6 -3,-0.3 -1,-0.1 -0.960 56.5-148.7-124.1 140.4 17.3 -4.3 2.6 6 -9 A L - 0 0 136 -2,-0.4 2,-0.1 -3,-0.1 -4,-0.1 -0.905 19.8-161.1-101.5 125.6 15.6 -4.4 -0.7 7 -8 A E - 0 0 138 -2,-0.6 2,-0.7 1,-0.1 -5,-0.0 -0.355 44.6 -51.8 -99.2-177.1 17.8 -3.2 -3.6 8 -7 A V S S+ 0 0 122 -2,-0.1 2,-0.3 2,-0.0 -1,-0.1 -0.365 78.9 135.4 -68.7 106.6 16.7 -2.1 -7.0 9 -6 A L - 0 0 121 -2,-0.7 2,-0.5 -3,-0.1 -3,-0.0 -0.999 41.6-156.6-148.6 146.5 14.4 -4.6 -8.5 10 -5 A F + 0 0 182 -2,-0.3 2,-0.4 1,-0.0 4,-0.1 -0.917 25.5 160.5-123.9 100.5 11.1 -4.9 -10.4 11 -4 A Q - 0 0 146 -2,-0.5 -2,-0.0 2,-0.1 -1,-0.0 -0.696 57.3 -28.0-122.1 74.7 9.6 -8.3 -10.0 12 -3 A G S S+ 0 0 51 -2,-0.4 -1,-0.0 19,-0.0 19,-0.0 -0.641 95.4 16.2 120.8-167.7 5.9 -8.0 -10.8 13 -2 A P - 0 0 73 0, 0.0 2,-0.2 0, 0.0 -2,-0.1 0.332 44.3-152.8 -43.1 155.2 3.0 -5.7 -10.9 14 -1 A G > - 0 0 59 1,-0.4 3,-0.7 -4,-0.1 2,-0.0 -0.222 50.5 -14.2 -94.3-155.6 3.0 -2.0 -10.8 15 0 A S T 3 S+ 0 0 102 1,-0.3 -1,-0.4 -2,-0.2 0, 0.0 -0.253 106.9 31.1 -80.3 173.7 -0.1 -0.4 -9.4 16 18 A D T 3 S+ 0 0 141 -3,-0.1 -1,-0.3 -2,-0.0 3,-0.1 -0.879 77.7 120.3 -97.0 30.5 -2.8 -0.3 -8.5 17 19 A A S < S- 0 0 31 -3,-0.7 0, 0.0 1,-0.1 0, 0.0 -0.292 74.1-113.0 -50.6 105.9 -2.5 -4.0 -7.5 18 20 A P - 0 0 64 0, 0.0 3,-0.1 0, 0.0 -1,-0.1 -0.026 32.1-173.2 -46.6 141.7 -3.3 -3.6 -3.8 19 21 A E S S+ 0 0 115 1,-0.3 7,-2.1 -3,-0.1 2,-0.3 0.656 72.0 22.5-106.2 -29.0 -0.5 -4.4 -1.3 20 22 A E E -A 25 0A 87 5,-0.2 2,-0.5 58,-0.0 -1,-0.3 -0.995 55.7-166.0-143.7 134.1 -2.5 -4.2 1.9 21 23 A E E > S-A 24 0A 90 3,-3.0 3,-1.5 -2,-0.3 0, 0.0 -0.933 83.1 -25.9-120.3 110.9 -6.2 -4.5 2.8 22 24 A D T 3 S- 0 0 123 -2,-0.5 44,-0.2 1,-0.3 -1,-0.1 0.871 127.5 -48.0 58.3 39.6 -7.1 -3.3 6.3 23 25 A H T 3 S+ 0 0 66 1,-0.2 2,-0.6 42,-0.1 54,-0.5 0.412 114.7 122.3 79.9 -0.7 -3.6 -4.0 7.6 24 26 A V E < -A 21 0A 4 -3,-1.5 -3,-3.0 52,-0.1 2,-0.2 -0.833 64.0-126.8 -96.1 123.4 -3.6 -7.4 6.0 25 27 A L E -Ab 20 78A 21 52,-2.9 54,-2.3 -2,-0.6 2,-0.6 -0.492 15.3-138.5 -71.1 130.4 -0.8 -8.1 3.5 26 28 A V E - b 0 79A 21 -7,-2.1 2,-0.4 -2,-0.2 54,-0.2 -0.811 24.9-166.6 -87.9 121.4 -2.0 -9.3 0.1 27 29 A L + 0 0 7 52,-2.7 54,-0.4 -2,-0.6 2,-0.3 -0.886 11.9 175.1-116.6 143.6 0.3 -12.1 -1.1 28 30 A R > - 0 0 39 -2,-0.4 3,-1.8 52,-0.1 4,-0.4 -0.811 51.5 -93.9-132.9 172.9 0.6 -13.6 -4.5 29 31 A K T 3 S+ 0 0 114 -2,-0.3 4,-0.1 1,-0.3 56,-0.0 0.468 126.7 55.8 -69.1 0.3 2.9 -16.2 -6.1 30 32 A S T 3 S+ 0 0 77 2,-0.1 -1,-0.3 1,-0.1 -19,-0.0 0.452 118.6 28.4-108.9 -6.4 5.0 -13.2 -7.2 31 33 A N S <> S+ 0 0 22 -3,-1.8 4,-0.5 3,-0.1 -2,-0.2 0.067 94.2 95.4-141.8 28.6 5.4 -11.7 -3.7 32 34 A F H > S+ 0 0 14 -4,-0.4 4,-1.8 2,-0.2 5,-0.1 0.924 84.8 41.1 -88.4 -49.6 5.3 -14.6 -1.4 33 35 A A H > S+ 0 0 74 1,-0.2 4,-1.7 2,-0.2 5,-0.1 0.798 113.3 55.8 -76.2 -28.3 8.9 -15.6 -0.8 34 36 A E H > S+ 0 0 85 2,-0.2 4,-1.6 1,-0.2 -1,-0.2 0.843 107.2 50.4 -66.1 -38.6 9.9 -12.0 -0.5 35 37 A A H X S+ 0 0 5 -4,-0.5 4,-1.7 2,-0.2 -2,-0.2 0.898 109.4 50.4 -67.6 -40.0 7.3 -11.6 2.2 36 38 A L H < S+ 0 0 3 -4,-1.8 -2,-0.2 1,-0.2 -1,-0.2 0.846 111.1 48.7 -69.0 -32.1 8.6 -14.6 4.1 37 39 A A H < S+ 0 0 80 -4,-1.7 -1,-0.2 1,-0.2 -2,-0.2 0.822 114.0 46.2 -75.1 -30.8 12.2 -13.3 3.9 38 40 A A H < S+ 0 0 72 -4,-1.6 2,-0.5 1,-0.2 -2,-0.2 0.732 111.3 53.1 -83.1 -23.3 11.2 -9.9 5.1 39 41 A H < - 0 0 45 -4,-1.7 67,-0.4 1,-0.1 3,-0.2 -0.914 56.5-168.6-121.7 110.2 9.0 -11.0 8.1 40 42 A K S S+ 0 0 76 -2,-0.5 65,-2.2 1,-0.2 2,-0.4 0.653 87.5 41.4 -68.0 -19.3 10.2 -13.4 10.7 41 43 A Y E S+C 104 0A 15 33,-0.3 35,-2.1 63,-0.2 2,-0.5 -0.802 74.7 157.9-130.1 105.8 6.7 -13.8 12.1 42 44 A L E -Cd 103 76A 0 61,-2.5 61,-2.8 -2,-0.4 2,-0.5 -0.963 25.6-161.2-134.8 116.2 4.0 -14.1 9.5 43 45 A L E -Cd 102 77A 0 33,-2.3 35,-2.7 -2,-0.5 2,-0.5 -0.844 17.9-163.4 -91.0 128.5 0.5 -15.6 9.8 44 46 A V E -Cd 101 78A 0 57,-2.8 57,-2.5 -2,-0.5 2,-0.5 -0.960 7.0-157.1-119.5 126.3 -1.0 -16.4 6.3 45 47 A E E -Cd 100 79A 6 33,-2.2 35,-2.7 -2,-0.5 2,-0.6 -0.872 2.3-159.4-100.7 125.9 -4.6 -17.1 5.6 46 48 A F E +Cd 99 80A 0 53,-1.8 53,-2.3 -2,-0.5 2,-0.2 -0.917 31.3 152.7-103.0 120.3 -5.6 -19.1 2.5 47 49 A Y E - d 0 81A 43 33,-2.4 35,-2.7 -2,-0.6 36,-0.5 -0.769 38.3-134.6-135.9 176.9 -9.2 -18.5 1.6 48 50 A A > - 0 0 0 -2,-0.2 3,-1.5 33,-0.2 7,-0.2 -0.994 24.3-126.6-134.9 146.6 -11.7 -18.4 -1.2 49 51 A P T 3 S+ 0 0 56 0, 0.0 6,-0.1 0, 0.0 -1,-0.1 0.764 106.6 51.3 -61.9 -27.1 -14.3 -15.7 -1.8 50 52 A W T 3 S+ 0 0 179 4,-0.1 2,-0.4 -3,-0.0 3,-0.1 0.390 83.3 106.4 -92.1 0.9 -17.3 -18.0 -1.8 51 53 A C <> - 0 0 15 -3,-1.5 4,-1.9 1,-0.1 5,-0.1 -0.678 60.2-152.4 -80.9 131.5 -16.5 -19.8 1.4 52 54 A G H > S+ 0 0 51 -2,-0.4 4,-2.0 1,-0.2 5,-0.2 0.854 93.8 58.6 -73.4 -34.8 -18.8 -18.8 4.2 53 55 A H H > S+ 0 0 106 2,-0.2 4,-1.5 1,-0.2 -1,-0.2 0.879 109.4 45.4 -60.7 -39.1 -16.2 -19.5 6.9 54 56 A C H > S+ 0 0 6 2,-0.2 4,-2.6 -6,-0.2 3,-0.3 0.954 108.5 53.9 -69.4 -52.1 -13.9 -17.0 5.3 55 57 A K H < S+ 0 0 141 -4,-1.9 -2,-0.2 1,-0.3 -1,-0.2 0.860 114.0 44.7 -50.0 -38.9 -16.5 -14.3 4.7 56 58 A A H < S+ 0 0 77 -4,-2.0 4,-0.4 1,-0.2 -1,-0.3 0.844 115.2 47.2 -71.9 -36.1 -17.3 -14.6 8.5 57 59 A L H >X S+ 0 0 13 -4,-1.5 4,-2.4 -3,-0.3 3,-0.7 0.785 89.8 82.9 -81.7 -29.6 -13.6 -14.7 9.5 58 60 A A H 3X S+ 0 0 53 -4,-2.6 4,-2.5 1,-0.2 5,-0.2 0.850 89.3 48.6 -46.1 -52.2 -12.3 -11.7 7.5 59 61 A P H 3> S+ 0 0 83 0, 0.0 4,-2.2 0, 0.0 -1,-0.2 0.848 113.5 46.4 -66.8 -32.2 -13.3 -8.9 9.8 60 62 A E H <> S+ 0 0 64 -3,-0.7 4,-2.6 -4,-0.4 -2,-0.2 0.861 110.8 52.9 -72.6 -34.5 -11.9 -10.5 12.9 61 63 A Y H X S+ 0 0 3 -4,-2.4 4,-1.8 1,-0.2 -1,-0.2 0.939 112.3 46.4 -63.2 -41.3 -8.7 -11.3 11.0 62 64 A A H X S+ 0 0 18 -4,-2.5 4,-2.8 -5,-0.2 -2,-0.2 0.916 110.1 53.0 -63.8 -45.9 -8.6 -7.6 10.1 63 65 A K H X S+ 0 0 98 -4,-2.2 4,-2.8 1,-0.2 5,-0.2 0.931 108.1 49.6 -57.6 -49.9 -9.3 -6.5 13.6 64 66 A A H X S+ 0 0 0 -4,-2.6 4,-2.0 1,-0.2 -1,-0.2 0.882 112.1 49.6 -57.0 -39.9 -6.4 -8.6 15.0 65 67 A A H X S+ 0 0 6 -4,-1.8 4,-2.1 -5,-0.2 -2,-0.2 0.910 110.6 49.5 -65.9 -43.3 -4.2 -7.1 12.4 66 68 A G H X S+ 0 0 18 -4,-2.8 4,-2.4 1,-0.2 -2,-0.2 0.911 112.1 47.3 -62.0 -44.4 -5.3 -3.6 13.3 67 69 A K H X S+ 0 0 79 -4,-2.8 4,-0.6 1,-0.2 -1,-0.2 0.863 110.5 53.4 -65.2 -36.7 -4.7 -4.2 17.0 68 70 A L H <>S+ 0 0 5 -4,-2.0 5,-2.2 -5,-0.2 3,-0.4 0.882 111.1 46.1 -65.5 -39.2 -1.3 -5.7 16.2 69 71 A K H ><5S+ 0 0 115 -4,-2.1 3,-2.4 1,-0.2 -2,-0.2 0.904 105.2 58.9 -69.7 -43.0 -0.3 -2.6 14.2 70 72 A A H 3<5S+ 0 0 92 -4,-2.4 -1,-0.2 1,-0.3 -2,-0.2 0.671 107.5 50.0 -60.7 -15.9 -1.6 -0.2 16.9 71 73 A E T 3<5S- 0 0 117 -4,-0.6 -1,-0.3 -3,-0.4 -2,-0.2 0.347 110.8-123.4-103.2 3.0 0.9 -1.9 19.2 72 74 A G T < 5 + 0 0 68 -3,-2.4 -3,-0.2 1,-0.2 -2,-0.1 0.811 50.6 172.5 58.3 31.6 3.8 -1.6 16.8 73 75 A S < - 0 0 34 -5,-2.2 -1,-0.2 1,-0.1 -2,-0.0 -0.318 41.4-133.3 -71.6 154.6 4.3 -5.3 16.9 74 76 A E S S+ 0 0 137 2,-0.0 -33,-0.3 -2,-0.0 2,-0.2 0.727 79.1 100.1 -75.9 -25.6 6.7 -7.2 14.6 75 77 A I - 0 0 7 -7,-0.1 2,-0.3 -35,-0.1 -33,-0.2 -0.455 55.0-170.2 -71.0 132.4 4.1 -9.7 13.8 76 78 A R E - d 0 42A 66 -35,-2.1 -33,-2.3 -2,-0.2 2,-0.4 -0.907 13.5-144.6-123.6 152.6 2.2 -9.4 10.5 77 79 A L E + d 0 43A 3 -54,-0.5 -52,-2.9 -2,-0.3 2,-0.3 -0.894 22.3 173.4-110.9 140.1 -0.9 -11.1 8.9 78 80 A A E -bd 25 44A 0 -35,-2.7 -33,-2.2 -2,-0.4 2,-0.3 -0.838 13.7-147.9-136.3 175.5 -1.3 -11.8 5.3 79 81 A K E -bd 26 45A 24 -54,-2.3 -52,-2.7 -2,-0.3 2,-0.4 -0.995 5.5-158.9-152.3 152.8 -3.7 -13.6 3.0 80 82 A V E - d 0 46A 0 -35,-2.7 -33,-2.4 -2,-0.3 2,-0.9 -0.996 18.1-141.0-134.1 120.4 -3.8 -15.6 -0.3 81 83 A D E >> - d 0 47A 19 -2,-0.4 4,-1.7 -54,-0.4 3,-0.8 -0.770 16.0-159.2 -84.2 113.5 -6.9 -16.0 -2.3 82 84 A A T 34 S+ 0 0 2 -35,-2.7 7,-0.2 -2,-0.9 -1,-0.2 0.764 83.6 66.4 -69.8 -26.3 -6.5 -19.6 -3.4 83 85 A T T 34 S+ 0 0 64 -36,-0.5 3,-0.3 1,-0.2 -1,-0.3 0.852 113.3 32.4 -68.0 -34.6 -8.8 -19.2 -6.4 84 86 A E T <4 S+ 0 0 144 -3,-0.8 -1,-0.2 1,-0.2 -2,-0.2 0.587 127.8 41.1 -97.2 -13.8 -6.4 -16.9 -8.0 85 87 A E X + 0 0 42 -4,-1.7 4,-1.7 1,-0.1 -1,-0.2 -0.521 67.5 146.8-124.9 86.8 -3.3 -18.5 -6.6 86 88 A S H > S+ 0 0 73 -3,-0.3 4,-2.9 2,-0.2 5,-0.2 0.842 71.0 51.6 -87.1 -38.0 -4.0 -22.2 -6.8 87 89 A D H > S+ 0 0 105 2,-0.2 4,-2.1 1,-0.2 -1,-0.2 0.939 110.9 50.8 -59.4 -48.4 -0.4 -23.4 -7.4 88 90 A L H > S+ 0 0 3 2,-0.2 4,-0.6 1,-0.2 -2,-0.2 0.939 114.4 42.2 -53.8 -52.4 0.7 -21.4 -4.5 89 91 A A H ><>S+ 0 0 3 -4,-1.7 5,-1.9 1,-0.2 3,-1.4 0.891 111.7 54.6 -64.2 -41.7 -2.0 -22.9 -2.2 90 92 A Q H ><5S+ 0 0 129 -4,-2.9 3,-1.6 1,-0.3 -1,-0.2 0.836 96.5 69.1 -58.9 -33.0 -1.4 -26.4 -3.7 91 93 A Q H 3<5S+ 0 0 135 -4,-2.1 -1,-0.3 1,-0.3 -2,-0.2 0.793 105.9 38.4 -56.0 -31.2 2.2 -25.9 -2.7 92 94 A Y T <<5S- 0 0 47 -3,-1.4 -1,-0.3 -4,-0.6 -2,-0.2 0.231 116.9-110.9-110.8 13.1 1.2 -26.2 0.9 93 95 A G T < 5 + 0 0 58 -3,-1.6 2,-0.6 1,-0.2 -3,-0.2 0.774 50.6 176.5 72.6 30.6 -1.4 -28.9 0.4 94 96 A V < + 0 0 10 -5,-1.9 2,-0.4 5,-0.1 -1,-0.2 -0.559 7.6 165.7 -76.7 113.8 -4.3 -26.6 1.2 95 97 A R + 0 0 212 -2,-0.6 2,-0.1 1,-0.2 -1,-0.0 -0.863 57.3 10.7-130.2 105.1 -7.5 -28.5 0.7 96 98 A G S S- 0 0 40 -2,-0.4 -1,-0.2 3,-0.1 -50,-0.1 -0.089 92.1 -53.7 99.9 147.5 -10.4 -26.7 2.2 97 99 A Y S S+ 0 0 69 1,-0.1 -44,-0.2 -2,-0.1 -50,-0.1 -0.889 99.1 17.7-130.7 154.3 -10.8 -23.1 3.6 98 100 A P + 0 0 22 0, 0.0 2,-0.5 0, 0.0 -51,-0.2 0.631 66.1 176.3 -80.3 154.4 -9.8 -21.2 5.4 99 101 A T E -C 46 0A 16 -53,-2.3 -53,-1.8 -2,-0.1 2,-0.4 -0.954 9.9-167.2-121.8 115.3 -6.3 -22.7 6.0 100 102 A I E -C 45 0A 11 -2,-0.5 14,-2.8 14,-0.4 2,-0.4 -0.850 7.2-179.8-109.8 130.6 -4.1 -20.6 8.3 101 103 A K E -CE 44 113A 22 -57,-2.5 -57,-2.8 -2,-0.4 2,-0.5 -0.986 18.9-140.0-138.1 139.3 -0.4 -21.2 8.7 102 104 A F E -CE 43 112A 8 10,-3.0 10,-2.0 -2,-0.4 2,-0.5 -0.838 13.4-158.5-109.1 126.2 2.2 -19.6 10.7 103 105 A F E -C 42 0A 1 -61,-2.8 -61,-2.5 -2,-0.5 2,-0.5 -0.890 1.5-161.0-108.6 130.5 5.7 -19.0 9.3 104 106 A R E > S-C 41 0A 37 -2,-0.5 3,-1.7 3,-0.4 -63,-0.2 -0.949 74.4 -13.6-112.6 124.0 8.8 -18.5 11.5 105 107 A N T 3 S- 0 0 101 -65,-2.2 -65,-0.2 -2,-0.5 -1,-0.1 0.730 116.4 -71.8 55.0 29.9 11.9 -16.9 10.0 106 108 A G T 3 S+ 0 0 19 -67,-0.4 2,-0.6 1,-0.2 -1,-0.3 0.526 88.3 150.9 70.6 7.8 10.7 -17.4 6.5 107 109 A D X - 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0 0 110 0, 0.0 -2,-0.0 0, 0.0 3,-0.0 -0.461 58.1-152.2 -73.1 131.7 11.2 -16.2 24.1 134 136 A A S S+ 0 0 28 -2,-0.2 2,-0.4 1,-0.1 48,-0.3 0.741 83.3 35.3 -78.7 -22.5 11.0 -20.0 23.4 135 137 A A S S- 0 0 4 46,-0.1 2,-0.4 21,-0.0 48,-0.3 -0.975 86.9-115.5-130.8 148.7 11.5 -20.8 27.1 136 138 A T E -f 183 0B 93 46,-2.1 48,-2.9 -2,-0.4 2,-0.4 -0.640 32.5-116.6 -81.3 132.2 10.4 -19.1 30.2 137 139 A T E -f 184 0B 103 -2,-0.4 48,-0.2 46,-0.2 -1,-0.1 -0.548 24.6-152.6 -71.3 122.9 13.2 -17.7 32.5 138 140 A L - 0 0 11 46,-3.2 49,-0.4 -2,-0.4 48,-0.4 -0.890 12.4-174.0-102.5 113.1 13.2 -19.4 35.9 139 141 A P - 0 0 82 0, 0.0 2,-0.3 0, 0.0 -1,-0.1 0.677 65.5 -12.3 -74.3 -21.5 14.7 -17.1 38.7 140 142 A D S > S- 0 0 73 49,-0.1 4,-2.0 1,-0.1 3,-0.5 -0.962 79.5 -76.1-170.1-179.6 14.6 -19.8 41.4 141 143 A G H > S+ 0 0 16 -2,-0.3 4,-2.9 1,-0.3 5,-0.3 0.830 119.4 57.9 -64.4 -41.3 13.6 -23.3 42.7 142 144 A A H > S+ 0 0 66 2,-0.2 4,-2.7 1,-0.2 -1,-0.3 0.900 108.8 48.4 -53.5 -41.0 10.0 -22.4 43.4 143 145 A A H > S+ 0 0 26 -3,-0.5 4,-2.0 2,-0.2 -2,-0.2 0.947 110.5 50.2 -67.3 -47.6 9.6 -21.3 39.8 144 146 A A H X S+ 0 0 0 -4,-2.0 4,-2.7 2,-0.2 5,-0.3 0.938 114.5 44.1 -51.4 -53.0 11.2 -24.5 38.5 145 147 A E H X S+ 0 0 105 -4,-2.9 4,-2.4 1,-0.2 -2,-0.2 0.939 110.1 54.4 -59.9 -51.0 8.9 -26.7 40.7 146 148 A S H X S+ 0 0 83 -4,-2.7 4,-0.6 -5,-0.3 -1,-0.2 0.863 112.2 47.4 -51.7 -36.5 5.8 -24.6 39.8 147 149 A L H >< S+ 0 0 24 -4,-2.0 3,-1.3 2,-0.2 4,-0.5 0.957 111.5 44.4 -75.4 -50.7 6.7 -25.3 36.2 148 150 A V H >< S+ 0 0 28 -4,-2.7 3,-0.8 1,-0.3 -2,-0.2 0.843 113.2 56.9 -62.8 -26.0 7.3 -29.0 36.2 149 151 A E H 3< S+ 0 0 121 -4,-2.4 -1,-0.3 -5,-0.3 -2,-0.2 0.703 96.5 63.1 -75.4 -20.7 4.2 -29.2 38.4 150 152 A S T << S+ 0 0 85 -3,-1.3 2,-0.3 -4,-0.6 -1,-0.2 0.550 104.4 41.7 -84.5 -11.2 1.9 -27.5 35.8 151 153 A S S < S- 0 0 30 -3,-0.8 3,-0.1 -4,-0.5 29,-0.0 -0.968 74.1-123.5-143.4 154.1 2.2 -30.1 33.1 152 154 A E S S+ 0 0 116 -2,-0.3 54,-2.6 1,-0.2 2,-0.3 0.843 108.4 17.7 -62.4 -35.3 2.3 -33.9 32.5 153 155 A V E S+G 205 0B 13 52,-0.2 2,-0.3 26,-0.2 52,-0.2 -0.998 73.9 171.3-138.2 138.7 5.7 -33.3 30.8 154 156 A A E -G 204 0B 1 50,-2.3 50,-2.9 -2,-0.3 2,-0.4 -0.985 17.2-147.1-146.1 155.3 8.0 -30.3 31.0 155 157 A V E -Gh 203 182B 1 26,-2.2 28,-2.1 -2,-0.3 2,-0.4 -0.981 11.0-172.2-130.8 131.1 11.6 -29.5 29.9 156 158 A I E -Gh 202 183B 0 46,-2.6 46,-2.4 -2,-0.4 2,-0.4 -0.970 8.8-154.6-127.2 131.9 14.2 -27.3 31.5 157 159 A G E -Gh 201 184B 0 26,-2.3 28,-2.3 -2,-0.4 2,-0.6 -0.923 6.3-152.8-100.8 144.6 17.6 -26.1 30.3 158 160 A F E +Gh 200 185B 0 42,-3.5 42,-1.6 -2,-0.4 2,-0.4 -0.918 27.7 157.0-119.3 111.0 20.4 -25.1 32.6 159 161 A F - 0 0 1 26,-2.5 3,-0.1 -2,-0.6 -2,-0.1 -0.996 36.3-153.7-140.5 130.9 22.8 -22.6 31.1 160 162 A K S S+ 0 0 94 -2,-0.4 2,-0.6 1,-0.2 -1,-0.2 0.973 96.2 38.9 -65.6 -55.8 25.2 -20.1 32.8 161 163 A D S > S- 0 0 94 1,-0.1 3,-1.0 2,-0.0 6,-0.2 -0.882 73.7-160.1 -96.1 121.1 25.2 -17.7 29.9 162 164 A V T 3 S+ 0 0 44 -2,-0.6 -1,-0.1 1,-0.2 -2,-0.1 0.687 91.1 51.4 -73.4 -19.7 21.7 -17.5 28.4 163 165 A E T 3 S+ 0 0 122 4,-0.1 -1,-0.2 -3,-0.1 5,-0.0 0.374 85.7 119.4 -97.6 2.1 23.0 -16.1 25.1 164 166 A S S <> S- 0 0 34 -3,-1.0 4,-2.2 1,-0.1 5,-0.1 -0.158 78.5-101.9 -65.9 162.9 25.7 -18.9 24.6 165 167 A D H > S+ 0 0 119 1,-0.2 4,-1.8 2,-0.2 5,-0.1 0.903 119.6 43.5 -51.0 -55.7 25.7 -21.3 21.6 166 168 A S H > S+ 0 0 42 1,-0.2 4,-2.4 2,-0.2 -1,-0.2 0.802 110.5 56.9 -66.4 -31.2 24.2 -24.3 23.3 167 169 A A H > S+ 0 0 0 -6,-0.2 4,-2.4 1,-0.2 -1,-0.2 0.929 106.9 50.9 -62.4 -45.2 21.6 -22.2 25.0 168 170 A K H X S+ 0 0 68 -4,-2.2 4,-1.6 1,-0.2 -2,-0.2 0.847 108.6 49.3 -65.2 -35.7 20.6 -21.0 21.6 169 171 A Q H X S+ 0 0 45 -4,-1.8 4,-2.1 2,-0.2 5,-0.2 0.940 109.6 52.6 -66.7 -42.6 20.3 -24.5 20.2 170 172 A F H X S+ 0 0 2 -4,-2.4 4,-2.1 1,-0.3 -2,-0.2 0.916 110.4 47.6 -55.1 -44.9 18.1 -25.4 23.3 171 173 A L H X S+ 0 0 28 -4,-2.4 4,-1.9 1,-0.2 -1,-0.3 0.827 105.9 60.4 -65.1 -31.7 15.9 -22.5 22.5 172 174 A Q H X S+ 0 0 78 -4,-1.6 4,-0.8 1,-0.2 -2,-0.2 0.910 108.1 42.8 -61.4 -43.4 15.9 -23.7 18.9 173 175 A A H >X S+ 0 0 1 -4,-2.1 4,-0.9 1,-0.2 3,-0.5 0.853 106.9 61.1 -72.0 -35.4 14.3 -26.9 20.0 174 176 A A H >< S+ 0 0 6 -4,-2.1 3,-0.7 1,-0.2 -2,-0.2 0.898 103.1 52.9 -58.2 -38.4 11.9 -25.1 22.3 175 177 A E H 3< S+ 0 0 67 -4,-1.9 -1,-0.2 1,-0.2 -2,-0.2 0.793 103.7 56.3 -64.0 -30.6 10.6 -23.3 19.2 176 178 A A H << S+ 0 0 35 -4,-0.8 2,-0.4 -3,-0.5 -1,-0.2 0.684 100.2 66.9 -80.2 -14.9 9.9 -26.6 17.4 177 179 A I << + 0 0 30 -4,-0.9 -1,-0.0 -3,-0.7 47,-0.0 -0.904 47.1 171.1-115.4 135.6 7.7 -28.0 20.1 178 180 A D S S+ 0 0 81 -2,-0.4 -1,-0.1 1,-0.1 -2,-0.0 0.670 71.7 60.1-112.0 -29.0 4.3 -26.7 21.1 179 181 A D S S+ 0 0 91 2,-0.1 -26,-0.2 1,-0.0 -1,-0.1 0.465 96.6 64.9 -92.5 -0.8 2.9 -29.3 23.4 180 182 A I S S- 0 0 9 -6,-0.1 2,-0.3 -28,-0.1 -26,-0.2 -0.977 78.5-128.2-121.5 137.5 5.5 -29.1 26.1 181 183 A P - 0 0 41 0, 0.0 -26,-2.2 0, 0.0 2,-0.3 -0.631 25.7-157.5 -74.9 138.6 6.4 -26.1 28.3 182 184 A F E - h 0 155B 10 -48,-0.3 -46,-2.1 -2,-0.3 2,-0.3 -0.893 11.4-178.3-117.7 149.1 10.0 -25.1 28.3 183 185 A G E -fh 136 156B 0 -28,-2.1 -26,-2.3 -2,-0.3 2,-0.3 -0.966 7.8-157.9-143.6 156.8 11.9 -23.2 30.9 184 186 A I E -fh 137 157B 6 -48,-2.9 -46,-3.2 -2,-0.3 2,-0.4 -0.995 7.5-171.7-139.3 144.3 15.5 -22.0 31.2 185 187 A T E - h 0 158B 2 -28,-2.3 -26,-2.5 -2,-0.3 -48,-0.0 -0.994 27.2-178.7-141.1 139.8 17.7 -21.0 34.1 186 188 A S + 0 0 67 -48,-0.4 2,-0.6 -2,-0.4 -1,-0.1 0.196 57.1 116.1-104.4 6.4 21.1 -19.4 34.8 187 189 A N >> - 0 0 42 -49,-0.4 4,-1.4 1,-0.1 3,-1.1 -0.703 56.0-153.9 -85.6 119.4 20.7 -19.7 38.7 188 190 A S H 3> S+ 0 0 71 -2,-0.6 4,-2.5 1,-0.3 5,-0.2 0.794 95.2 61.8 -64.9 -30.0 23.3 -22.1 40.2 189 191 A D H 3> S+ 0 0 116 2,-0.2 4,-2.2 1,-0.2 -1,-0.3 0.854 104.5 49.4 -55.9 -37.5 20.9 -22.8 43.1 190 192 A V H <> S+ 0 0 0 -3,-1.1 4,-1.0 2,-0.2 -2,-0.2 0.843 106.5 55.2 -77.5 -30.1 18.6 -24.2 40.5 191 193 A F H ><>S+ 0 0 16 -4,-1.4 5,-2.0 2,-0.2 3,-0.8 0.952 110.9 45.5 -57.8 -52.0 21.4 -26.3 39.1 192 194 A S H ><5S+ 0 0 85 -4,-2.5 3,-2.1 1,-0.3 -2,-0.2 0.892 101.6 64.7 -59.6 -43.6 22.0 -27.8 42.5 193 195 A K H 3<5S+ 0 0 65 -4,-2.2 -1,-0.3 1,-0.3 -2,-0.2 0.840 113.9 35.0 -48.8 -34.2 18.3 -28.4 43.1 194 196 A Y T <<5S- 0 0 23 -4,-1.0 -1,-0.3 -3,-0.8 -2,-0.2 0.124 112.2-113.8-115.8 20.5 18.6 -30.9 40.2 195 197 A Q T < 5 + 0 0 138 -3,-2.1 -3,-0.2 1,-0.2 2,-0.2 0.711 52.9 168.3 63.3 28.0 22.1 -32.3 40.7 196 198 A L < - 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